## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
A |
45 |
13 |
10000 |
x |
A |
x,y-1,z |
1_545 |
57 |
20 |
10000 |
551.8 |
-7.6 |
0.149 |
6 |
2 |
0 |
0.000 |
2 |
|
A |
61 |
21 |
10000 |
◊ |
E |
x-1/2,y+1/2,z |
3_455 |
57 |
6 |
1862 |
502.6 |
-6.5 |
0.579 |
6 |
0 |
0 |
0.223 |
3 |
|
P |
48 |
5 |
1784 |
◊ |
B |
x,y,z |
1_555 |
56 |
20 |
9611 |
437.5 |
-8.7 |
0.434 |
7 |
0 |
0 |
0.286 |
4 |
|
B |
39 |
12 |
9611 |
◊ |
A |
-x+1/2,y-1/2,-z+1 |
4_546 |
37 |
14 |
10000 |
397.0 |
-7.4 |
0.091 |
4 |
0 |
0 |
0.000 |
5 |
|
P |
41 |
4 |
1784 |
◊ |
A |
x,y,z |
1_555 |
55 |
16 |
10000 |
366.6 |
-2.8 |
0.704 |
11 |
0 |
0 |
0.168 |
6 |
|
E |
43 |
4 |
1862 |
◊ |
B |
x,y,z |
1_555 |
47 |
14 |
9611 |
363.7 |
-1.7 |
0.722 |
6 |
0 |
0 |
0.000 |
7 |
|
B |
35 |
14 |
9611 |
◊ |
A |
x,y,z |
1_555 |
28 |
8 |
10000 |
295.6 |
-2.0 |
0.488 |
1 |
0 |
0 |
0.024 |
8 |
|
B |
23 |
8 |
9611 |
x |
B |
x,y-1,z |
1_545 |
27 |
8 |
9611 |
273.2 |
-2.7 |
0.260 |
3 |
2 |
0 |
0.000 |
9 |
|
[CPQ]B:404 |
17 |
1 |
560 |
f |
B |
x,y,z |
1_555 |
31 |
8 |
9611 |
224.7 |
-1.0 |
0.293 |
0 |
0 |
0 |
0.024 |
10 |
|
A |
29 |
8 |
10000 |
◊ |
E |
-x+1/2,y-1/2,-z+1 |
4_546 |
22 |
3 |
1862 |
213.7 |
-2.3 |
0.453 |
0 |
0 |
0 |
0.000 |
11 |
|
[BRU]P:5 |
19 |
1 |
442 |
◊ |
A |
x,y,z |
1_555 |
31 |
9 |
10000 |
209.4 |
0.9 |
0.577 |
3 |
0 |
0 |
0.010 |
12 |
|
[BRU]E:5 |
19 |
1 |
441 |
◊ |
B |
x,y,z |
1_555 |
32 |
9 |
9611 |
208.1 |
1.9 |
0.701 |
3 |
0 |
0 |
0.000 |
13 |
|
A |
19 |
5 |
10000 |
◊ |
B |
x-1/2,y+3/2,z |
3_465 |
25 |
9 |
9611 |
203.3 |
-2.3 |
0.356 |
0 |
0 |
0 |
0.000 |
14 |
|
A |
23 |
10 |
10000 |
◊ |
B |
x-1/2,y+1/2,z |
3_455 |
20 |
7 |
9611 |
199.4 |
1.2 |
0.795 |
1 |
0 |
0 |
0.000 |
15 |
|
A |
20 |
7 |
10000 |
x |
A |
-x,y-1,-z+1 |
2_546 |
17 |
6 |
10000 |
186.6 |
0.4 |
0.709 |
2 |
1 |
0 |
0.000 |
16 |
|
[BRU]E:5 |
14 |
1 |
441 |
cf |
E |
x,y,z |
1_555 |
19 |
2 |
1862 |
142.6 |
0.8 |
0.619 |
0 |
0 |
0 |
0.000 |
17 |
|
[BRU]P:5 |
14 |
1 |
442 |
cf |
P |
x,y,z |
1_555 |
18 |
2 |
1784 |
142.4 |
0.9 |
0.635 |
0 |
0 |
0 |
0.000 |
18 |
|
B |
13 |
5 |
9611 |
◊ |
B |
-x,y,-z |
2_555 |
13 |
5 |
9611 |
129.9 |
0.9 |
0.810 |
4 |
0 |
0 |
0.000 |
19 |
|
[DIO]A:402 |
6 |
1 |
218 |
◊ |
A |
x,y,z |
1_555 |
19 |
9 |
10000 |
126.4 |
4.0 |
0.210 |
0 |
0 |
0 |
0.000 |
20 |
|
[DIO]A:401 |
6 |
1 |
217 |
f |
A |
x,y,z |
1_555 |
18 |
10 |
10000 |
124.9 |
4.1 |
0.226 |
1 |
0 |
0 |
0.000 |
21 |
|
[DIO]B:403 |
6 |
1 |
217 |
◊ |
B |
x,y,z |
1_555 |
18 |
10 |
9611 |
119.9 |
4.4 |
0.233 |
0 |
0 |
0 |
0.000 |
22 |
|
A |
11 |
4 |
10000 |
◊ |
A |
-x,y,-z+1 |
2_556 |
11 |
4 |
10000 |
114.1 |
1.6 |
0.862 |
4 |
0 |
0 |
0.000 |
23 |
|
[DIO]B:401 |
6 |
1 |
217 |
f |
B |
x,y,z |
1_555 |
15 |
5 |
9611 |
101.5 |
3.9 |
0.113 |
0 |
0 |
0 |
0.000 |
24 |
|
[SO4]A:405 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
15 |
8 |
10000 |
101.1 |
-14.6 |
0.718 |
2 |
0 |
0 |
0.375 |
25 |
|
[CPQ]B:404 |
7 |
1 |
560 |
◊ |
B |
-x,y,-z |
2_555 |
10 |
2 |
9611 |
87.5 |
1.1 |
0.437 |
0 |
0 |
0 |
0.000 |
26 |
|
[GOL]B:408 |
6 |
1 |
221 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
9611 |
84.9 |
0.3 |
0.609 |
2 |
0 |
0 |
0.014 |
27 |
|
[GOL]A:406 |
5 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
16 |
4 |
10000 |
83.8 |
0.0 |
0.586 |
2 |
0 |
0 |
0.021 |
28 |
|
[SO4]B:405 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
9611 |
82.1 |
-11.5 |
0.843 |
3 |
0 |
0 |
0.311 |
29 |
|
[DIO]B:402 |
6 |
1 |
217 |
f |
B |
x,y-1,z |
1_545 |
14 |
8 |
9611 |
80.0 |
1.4 |
0.017 |
0 |
0 |
0 |
0.000 |
30 |
|
[SO4]B:407 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
9611 |
78.3 |
-11.7 |
0.736 |
2 |
0 |
0 |
0.306 |
31 |
|
[DIO]B:402 |
5 |
1 |
217 |
◊ |
B |
x,y,z |
1_555 |
11 |
4 |
9611 |
76.3 |
1.9 |
0.138 |
1 |
0 |
0 |
0.000 |
32 |
|
[SO4]A:403 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
10000 |
73.1 |
-8.3 |
0.964 |
3 |
0 |
0 |
0.233 |
33 |
|
[SO4]A:404 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
10000 |
70.8 |
-8.6 |
0.913 |
4 |
0 |
0 |
0.252 |
34 |
|
[CPQ]B:404 |
7 |
1 |
560 |
◊ |
[CPQ]B:404 |
-x,y,-z |
2_555 |
7 |
1 |
560 |
69.9 |
1.9 |
0.506 |
0 |
0 |
0 |
0.000 |
35 |
|
A |
8 |
5 |
10000 |
◊ |
[BRU]E:5 |
x-1/2,y+1/2,z |
3_455 |
6 |
1 |
441 |
63.9 |
-1.1 |
0.313 |
1 |
0 |
0 |
0.036 |
36 |
|
[BRU]P:5 |
6 |
1 |
442 |
◊ |
B |
x,y,z |
1_555 |
8 |
5 |
9611 |
61.3 |
-1.3 |
0.304 |
1 |
0 |
0 |
0.043 |
37 |
|
[SO4]B:406 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
7 |
2 |
9611 |
58.7 |
-6.4 |
0.954 |
3 |
0 |
0 |
0.187 |
38 |
|
[SO4]A:404 |
5 |
1 |
185 |
◊ |
A |
x,y-1,z |
1_545 |
7 |
3 |
10000 |
57.0 |
-7.8 |
0.579 |
0 |
0 |
0 |
0.000 |
39 |
|
[DIO]A:402 |
4 |
1 |
218 |
f |
A |
x,y-1,z |
1_545 |
6 |
4 |
10000 |
53.7 |
1.3 |
0.061 |
0 |
0 |
0 |
0.000 |
40 |
|
B |
8 |
4 |
9611 |
◊ |
[GOL]B:408 |
x,y-1,z |
1_545 |
4 |
1 |
221 |
52.9 |
-0.2 |
0.521 |
0 |
0 |
0 |
0.000 |
41 |
|
[GOL]A:406 |
4 |
1 |
216 |
◊ |
B |
x,y-1,z |
1_545 |
6 |
2 |
9611 |
47.7 |
0.2 |
0.620 |
0 |
0 |
0 |
0.000 |
42 |
|
B |
5 |
4 |
9611 |
◊ |
E |
x,y-1,z |
1_545 |
5 |
1 |
1862 |
42.8 |
-0.2 |
0.552 |
0 |
0 |
0 |
0.000 |
43 |
|
A |
2 |
1 |
10000 |
◊ |
[SO4]B:406 |
-x+1/2,y-1/2,-z+1 |
4_546 |
3 |
1 |
186 |
30.5 |
-2.5 |
0.981 |
1 |
0 |
0 |
0.000 |
44 |
|
[DIO]B:403 |
2 |
1 |
217 |
f |
B |
-x,y,-z |
2_555 |
4 |
3 |
9611 |
20.4 |
0.7 |
0.269 |
0 |
0 |
0 |
0.000 |
45 |
|
[SO4]A:404 |
2 |
1 |
185 |
◊ |
P |
x,y,z |
1_555 |
3 |
1 |
1784 |
19.4 |
-3.2 |
0.636 |
0 |
0 |
0 |
0.069 |
46 |
|
A |
2 |
1 |
10000 |
◊ |
B |
x,y-1,z |
1_545 |
2 |
1 |
9611 |
14.3 |
0.3 |
0.789 |
0 |
0 |
0 |
0.000 |
47 |
|
[SO4]A:403 |
1 |
1 |
186 |
◊ |
P |
x,y,z |
1_555 |
2 |
2 |
1784 |
14.1 |
-2.5 |
0.523 |
0 |
0 |
0 |
0.055 |
48 |
|
[BRU]P:5 |
2 |
1 |
442 |
◊ |
[SO4]A:403 |
x,y,z |
1_555 |
2 |
1 |
186 |
11.3 |
-1.6 |
0.590 |
0 |
0 |
0 |
0.035 |
49 |
|
[SO4]B:406 |
1 |
1 |
186 |
◊ |
E |
x,y,z |
1_555 |
2 |
2 |
1862 |
5.7 |
-1.0 |
0.548 |
0 |
0 |
0 |
0.000 |
50 |
|
[BRU]E:5 |
2 |
1 |
441 |
◊ |
[SO4]B:406 |
x,y,z |
1_555 |
1 |
1 |
186 |
5.1 |
-0.7 |
0.564 |
0 |
0 |
0 |
0.000 |
51 |
|
[SO4]B:405 |
2 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
10000 |
3.1 |
-0.4 |
0.639 |
0 |
0 |
0 |
0.004 |
|